N-[2-(4-methoxyphenyl)ethyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O5S/c1-12-3-8-15(11-16(12)18(19)20)24(21,22)17-10-9-13-4-6-14(23-2)7-5-13/h3-8,11,17H,9-10H2,1-2H3